# generated using pymatgen data_Hf3Zr8Ta9Si16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.90612825 _cell_length_b 6.90443690 _cell_length_c 12.70913687 _cell_angle_alpha 90.11584480 _cell_angle_beta 89.88378528 _cell_angle_gamma 90.00238731 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Zr8Ta9Si16 _chemical_formula_sum 'Hf3 Zr8 Ta9 Si16' _cell_volume 606.00635622 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Hf Hf0 1 0.50096303 0.35044926 0.62223083 1.0 Hf Hf1 1 0.50055348 0.65000026 0.12398665 1.0 Hf Hf2 1 0.14895879 0.99988802 0.87328975 1.0 Zr Zr3 1 0.00195094 0.65672973 0.03224784 1.0 Zr Zr4 1 0.99778590 0.34246626 0.52974209 1.0 Zr Zr5 1 0.65961429 0.00049302 0.96904174 1.0 Zr Zr6 1 0.15624322 0.49835301 0.78071915 1.0 Zr Zr7 1 0.84319379 0.50181030 0.28135105 1.0 Zr Zr8 1 0.50027911 0.15957995 0.22012556 1.0 Zr Zr9 1 0.50100222 0.84040848 0.71819433 1.0 Zr Zr10 1 0.33942085 0.00018187 0.46886167 1.0 Ta Ta11 1 0.34813351 0.50732941 0.37684323 1.0 Ta Ta12 1 0.85101343 0.99751111 0.37364467 1.0 Ta Ta13 1 0.00730634 0.15223122 0.12665637 1.0 Ta Ta14 1 0.99250911 0.84893198 0.62690189 1.0 Ta Ta15 1 0.65183608 0.49201711 0.87666312 1.0 Ta Ta16 1 0.67192863 0.67377799 0.49933034 1.0 Ta Ta17 1 0.82714455 0.17046012 0.74964825 1.0 Ta Ta18 1 0.17203120 0.83129574 0.25127193 1.0 Ta Ta19 1 0.32942736 0.32676648 0.00041943 1.0 Si Si20 1 0.04530769 0.70401608 0.43655477 1.0 Si Si21 1 0.95379007 0.29860366 0.93656991 1.0 Si Si22 1 0.70173932 0.04545185 0.56244542 1.0 Si Si23 1 0.20225900 0.45353198 0.18707162 1.0 Si Si24 1 0.79823438 0.54655993 0.68613639 1.0 Si Si25 1 0.45448516 0.20011699 0.81385412 1.0 Si Si26 1 0.54791124 0.80044986 0.31469366 1.0 Si Si27 1 0.29983950 0.95467788 0.06459375 1.0 Si Si28 1 0.85787842 0.78858551 0.82199811 1.0 Si Si29 1 0.13731507 0.20977294 0.32281955 1.0 Si Si30 1 0.79751626 0.86574424 0.17883007 1.0 Si Si31 1 0.28858050 0.64143517 0.57184417 1.0 Si Si32 1 0.71067202 0.35814242 0.07216718 1.0 Si Si33 1 0.63656276 0.29330725 0.42554991 1.0 Si Si34 1 0.36383092 0.70229850 0.92709683 1.0 Si Si35 1 0.20278187 0.13662738 0.67660165 1.0